%chk=000184183.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184183

0 1
O -2.773006 2.526215 0.032233
N -2.993209 0.293923 0.811571
C -4.008358 -0.746365 1.042783
C -5.364412 -0.073939 0.641244
C -5.008483 1.368188 0.180412
C -3.483922 1.497801 0.318410
C -1.558409 0.061489 1.052139
C -0.961876 -0.927826 0.068948
C -0.306707 -2.094261 0.345154
C 0.236613 -2.950324 -0.792459
C 1.777706 -3.195997 -0.732555
C 2.571428 -1.925659 -0.947238
C 3.530439 -1.372980 -0.152948
C 4.216844 -0.076042 -0.569154
C -0.057068 -2.629897 1.746246
C 3.714332 1.181637 0.218677
C 4.013210 -1.960939 1.163741
C 2.314916 1.604914 -0.183703
C 1.887022 2.839580 -0.580730
C 0.433451 3.075479 -0.961643
C 2.764548 4.078157 -0.672635
H -3.787122 -1.642395 0.431507
H -4.000989 -1.060683 2.105965
H -5.852936 -0.643500 -0.166390
H -6.057019 -0.060236 1.498870
H -5.286526 1.568243 -0.868948
H -5.488440 2.150527 0.793806
H -1.411610 -0.264624 2.098889
H -1.075258 1.052162 0.938409
H -1.077347 -0.632966 -0.984913
H -0.014573 -2.483274 -1.764554
H -0.263893 -3.942548 -0.772327
H 2.026809 -3.926163 -1.531741
H 2.045108 -3.688238 0.219954
H 2.329551 -1.392221 -1.881173
H 5.310269 -0.172777 -0.401504
H 4.069190 0.105935 -1.650378
H -0.221173 -3.724299 1.780042
H 0.991309 -2.451505 2.055881
H -0.706044 -2.164969 2.506720
H 3.740626 0.952456 1.305621
H 4.436420 2.003584 0.062806
H 3.408369 -2.815834 1.508467
H 5.061694 -2.308970 1.071057
H 4.005967 -1.194950 1.963521
H 1.569444 0.794691 -0.154541
H -0.180382 2.161873 -0.878168
H -0.035020 3.844193 -0.315498
H 0.353657 3.449377 -2.002569
H 2.428677 4.844833 0.054425
H 3.830689 3.876705 -0.479556
H 2.679094 4.540020 -1.676369


%chk=000184183-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000184183

0 1
O -2.835744 2.578606 0.279923
N -2.997730 0.289310 0.833166
C -4.025198 -0.744055 1.063919
C -5.295907 -0.140137 0.396845
C -5.048071 1.390260 0.420597
C -3.516975 1.531280 0.484094
C -1.561610 0.055883 1.068594
C -0.971610 -0.931797 0.080776
C -0.323636 -2.100460 0.358313
C 0.225851 -2.964806 -0.771290
C 1.770439 -3.205653 -0.714303
C 2.579379 -1.946723 -0.949850
C 3.521959 -1.374780 -0.144803
C 4.232286 -0.091509 -0.571340
C -0.084332 -2.631336 1.762518
C 3.731494 1.195558 0.168762
C 3.956099 -1.926979 1.203078
C 2.337902 1.609641 -0.259060
C 1.914420 2.845751 -0.656925
C 0.470152 3.081610 -1.071434
C 2.792699 4.084990 -0.716859
H -3.719903 -1.704203 0.610457
H -4.171827 -0.910701 2.152490
H -5.369304 -0.493156 -0.646768
H -6.217521 -0.438541 0.923148
H -5.442050 1.921958 -0.460270
H -5.479438 1.872106 1.318642
H -1.406180 -0.272721 2.114257
H -1.078346 1.046484 0.957541
H -1.086898 -0.635586 -0.972752
H -0.028743 -2.509142 -1.747693
H -0.268632 -3.959698 -0.739123
H 2.013899 -3.946865 -1.504655
H 2.036171 -3.683619 0.245881
H 2.364700 -1.440675 -1.905447
H 5.319742 -0.198100 -0.373984
H 4.111812 0.066450 -1.659593
H -0.241496 -3.726645 1.796618
H 0.959307 -2.445352 2.083091
H -0.744799 -2.169060 2.515043
H 3.753110 1.005682 1.263331
H 4.457720 2.008724 -0.014689
H 3.384933 -2.817212 1.514153
H 5.028010 -2.207937 1.178723
H 3.850158 -1.161223 1.996405
H 1.597679 0.794390 -0.250390
H -0.122313 2.151490 -1.072157
H -0.040978 3.790655 -0.391481
H 0.418417 3.524074 -2.086815
H 2.398147 4.870448 -0.041470
H 3.840770 3.893332 -0.434058
H 2.785582 4.517589 -1.737352


